Compound Detail
CHEMBL5428605
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL5428605 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BJTCFEBEKUDUBE-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
430.9
MW (Da)
4.46
ALogP
5
HBA
3
HBD
82.0
PSA (Ų)
0.40
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.63
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Amine oxidase [flavin-containing] A CHEMBL3681 | IC50 | 5.63 | 5.63 | 2360.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Amine oxidase [flavin-containing] A | IC50 | = | 2360.0 | nM | 5.63 | Inhibition of MAO A in mouse GL26 cells preincubated for 20 mins followed by 14C... | 37172473 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37172473 | 10.1016/j.ejmech.2023.115459 | Amine oxidase [flavin-containing] A | 1 |
Data from ChEMBL 36 via Core Engine